Cas no 90650-44-5 (8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers))

8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers) structure
90650-44-5 structure
Product Name:8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers)
CAS No:90650-44-5
MF:C33H37N5O6
MW:599.67678809166
CID:810181
PubChem ID:146217
Update Time:2025-07-31

8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers) Chemical and Physical Properties

Names and Identifiers

    • Ergotaman-3',6',18-trione,9,10-dihydro-8',12'-dihydroxy-2'-methyl-5'-(phenylmethyl)-, (5'a,10a)-
    • 8?-Hydroxy Dihydro Ergotamine (Mixture of Diastereomers)
    • 8'-HYDROXY DIHYDRO ERGOTAMINE
    • 8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers)
    • A)-9,10-Dihydro-8',12'-dihydroxy-2'-methyl-5'-(phenylmethyl)ergotaman-3',6',18-trione
    • A,10
    • DTXSID60920250
    • SCHEMBL1299430
    • (6aR,9R)-N-[(1S,2S,4R,7S)-7-benzyl-2,10-dihydroxy-4-methyl-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
    • 2T3XF8853Y
    • 8'-Hydroxydihydroergotamine
    • N-(5-Benzyl-8,10b-dihydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)-6-methylergoline-8-carboximidic acid
    • UNII-2T3XF8853Y
    • 90650-44-5
    • Ergotaman-3',6',18-trione, 9,10-dihydro-8',12'-dihydroxy-2'-methyl-5'-(phenylmethyl)-, (5'alpha,10alpha)-
    • Inchi： 1S/C33H37N5O6/c1-32(35-29(40)20-14-22-21-9-6-10-23-28(21)19(16-34-23)15-24(22)36(2)17-20)31(42)38-25(13-18-7-4-3-5-8-18)30(41)37-26(11-12-27(37)39)33(38,43)44-32/h3-10,16,20,22,24-27,34,39,43H,11-15,17H2,1-2H3,(H,35,40)/t20-,22?,24-,25+,26+,27?,32-,33+/m1/s1
    • InChI Key： AHRNWGXNCFKOII-UYPVSMPXSA-N
    • SMILES： O1[C@](C)(C(N2[C@@H](CC3C=CC=CC=3)C(N3C(CC[C@H]3[C@]12O)O)=O)=O)NC([C@H]1CN(C)[C@@H]2CC3=CNC4=CC=CC(=C34)C2C1)=O

Computed Properties

  • Exact Mass: 599.27400
  • Monoisotopic Mass: 599.27438392g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 44
  • Rotatable Bond Count: 4
  • Complexity: 1200
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 6
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 4
  • XLogP3: 1.8
  • Topological Polar Surface Area: 138?2

Experimental Properties

  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 937.6±65.0 °C at 760 mmHg
  • Flash Point: 520.8±34.3 °C
  • PSA: 138.44000
  • LogP: 1.60410
  • Vapor Pressure: 0.0±0.3 mmHg at 25°C

8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers) Security Information

8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers) Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
H941350-0.5mg
8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers)
 90650-44-5
0.5mg
 $ 2365.00 2022-06-04
TRC
H941350-10mg
8'-Hydroxy Dihydro Ergotamine (Mixture of Diastereomers)
 90650-44-5
10mg
 $31014.00 2023-05-18
TRC
H941350-25mg
8'-Hydroxy Dihydro Ergotamine (Mixture of Diastereomers)
 90650-44-5
25mg
 $ 51000.00 2023-09-07
TRC
H941350-.5mg
8'-Hydroxy Dihydro Ergotamine (Mixture of Diastereomers)
 90650-44-5
5mg
 $2853.00 2023-05-18

8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers) Related Literature

Related Categories

90650-44-5 (8'-Hydroxy Dihydro Ergotamine(Mixture of Diastereomers)) Related Products

Recommended suppliers
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Shanghai Aoguang Biotechnology Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shanghai Aoguang Biotechnology Co., Ltd
Shandong Jing Kun Chemical Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shandong Jing Kun Chemical Co.,Ltd.
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent