Cas no 101899-45-0 (3-Pyrrolidineaceticacid, 2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexen-1-yl]-, (2S,3S,4S)-)

3-Pyrrolidineaceticacid, 2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexen-1-yl]-, (2S,3S,4S)- structure
101899-45-0 structure
Product Name:3-Pyrrolidineaceticacid, 2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexen-1-yl]-, (2S,3S,4S)-
CAS No:101899-45-0
MF:C15H21NO6
MW:311.33034491539
CID:208356
Update Time:2024-03-01

3-Pyrrolidineaceticacid, 2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexen-1-yl]-, (2S,3S,4S)- Chemical and Physical Properties

Names and Identifiers

    • 3-Pyrrolidineaceticacid, 2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexen-1-yl]-, (2S,3S,4S)-
    • 3-Pyrrolidineacetic acid,2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexenyl]-, (2S,3S,4S)- (9CI)
    • 3-Pyrrolidineaceticacid, 2-carboxy-4-(5-carboxy-1-methylene-4-hexenyl)-, [2S-[2a,3b,4b(E)]]-
    • Isodomoic acid C
    • Inchi: 1S/C15H21NO6/c1-8(4-3-5-9(2)14(19)20)11-7-16-13(15(21)22)10(11)6-12(17)18/h5,10-11,13,16H,1,3-4,6-7H2,2H3,(H,17,18)(H,19,20)(H,21,22)/b9-5+/t10-,11+,13-/m0/s1
    • InChI Key: OKFIHTSZDXUGQB-PGPNUJALSA-N
    • SMILES: N1C[C@H](C(=C)CC/C=C(/C(O)=O)\C)[C@H](CC(O)=O)[C@H]1C(O)=O

Computed Properties

  • Exact Mass: 311.13693

Experimental Properties

  • PSA: 123.93

3-Pyrrolidineaceticacid, 2-carboxy-4-[(4E)-5-carboxy-1-methylene-4-hexen-1-yl]-, (2S,3S,4S)- Related Literature

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