Cas no 102644-20-2 (5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione,1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-a-L-threo-pentopyranosyl]-4-O-methyl-b-D-glucopyranosyl]-12,13-dihydro-6-methyl-)

5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione,1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-a-L-threo-pentopyranosyl]-4-O-methyl-b-D-glucopyranosyl]-12,13-dihydro-6-methyl- structure
102644-20-2 structure
Product Name:5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione,1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-a-L-threo-pentopyranosyl]-4-O-methyl-b-D-glucopyranosyl]-12,13-dihydro-6-methyl-
CAS No:102644-20-2
MF:C34H35ClN4O9
MW:679.116108179092
CID:154010
PubChem ID:128141
Update Time:2025-04-19

5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione,1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-a-L-threo-pentopyranosyl]-4-O-methyl-b-D-glucopyranosyl]-12,13-dihydro-6-methyl- Chemical and Physical Properties

Names and Identifiers

    • 5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione,1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-a-L-threo-pentopyranosyl]-4-O-methyl-b-D-glucopyranosyl]-12,13-dihydro-6-methyl-
    • 5H-Indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione,1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-a-L-threo-pentopyranosyl]
    • 5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole-5,7(6H)-dione, 1-chloro-13-[6-O-[2,4-dideoxy-4-(methylamino)-alpha-L-threo-pentopyranosyl]-4-O-methyl-beta-D-glucopyranosyl]-12,13-dihydro-6-methyl-
    • AT-2433 A1
    • CHEBI:222273
    • AT2433-A1
    • AT 2433-A1
    • 5H-Indolo(2,3-a)pyrrolo(3,4-c)carbazole-5,7(6H)-dione, 1-chloro-13-(6-O-(2,4-dideoxy-4-(methylamino)pentopyranosyl)-4-O-methylhexopyranosyl)-12,13-dihydro-6-methyl-
    • CHEMBL3589063
    • 5-Chloro-3-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-[[(2S,4S,5S)-4-hydroxy-5-(methylamino)oxan-2-yl]oxymethyl]-5-methoxyoxan-2-yl]-13-methyl-3,13,23-triazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17,19,21-nonaene-12,14-dione
    • 102644-20-2
    • AT 2433A1
    • Inchi: 1S/C34H35ClN4O9/c1-36-18-12-46-21(11-19(18)40)47-13-20-31(45-3)29(41)30(42)34(48-20)39-27-15(8-6-9-16(27)35)23-25-24(32(43)38(2)33(25)44)22-14-7-4-5-10-17(14)37-26(22)28(23)39/h4-10,18-21,29-31,34,36-37,40-42H,11-13H2,1-3H3/t18-,19-,20+,21-,29+,30+,31+,34+/m0/s1
    • InChI Key: CGQSZYLXZOKJEJ-VYCQBBBDSA-N
    • SMILES: ClC1=CC=CC2=C1N(C1=C3C(C4C=CC=CC=4N3)=C3C(N(C)C(C3=C12)=O)=O)[C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO[C@H]2C[C@@H]([C@H](CO2)NC)O)O1)OC)O)O

Computed Properties

  • Exact Mass: 678.209256
  • Monoisotopic Mass: 678.209256
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 48
  • Rotatable Bond Count: 6
  • Complexity: 1240
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 8
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 168
  • XLogP3: 1.9

Experimental Properties

  • Density: 1.69
  • Boiling Point: 909.1°Cat760mmHg
  • Flash Point: 503.6°C
  • Refractive Index: 1.772
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