2-Amino-9-methyl-4,8-heptadecadiene-1,3-diol; (2S,3R,4E,8E)-form, N-(2R-Hydroxy-3E-nonadecenoyl), 1-O-β-D-glucopyranoside 

AlkaPlorer ID: AK286249

Synonym: Chrysogeside D

IUPAC Name: None

Structure

SMILES: CCCCCCCCCCCCCCC/C=C\C(O)C(=O)NC(COC1OC(CO)C(O)C(O)C1O)C(O)/C=C/CC/C=C(\C)CCCCCCCC

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InChI: InChI=1S/C43H79NO9/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-22-26-31-37(47)42(51)44-35(33-52-43-41(50)40(49)39(48)38(32-45)53-43)36(46)30-27-23-25-29-34(3)28-24-21-11-9-7-5-2/h26-27,29-31,35-41,43,45-50H,4-25,28,32-33H2,1-3H3,(H,44,51)/b30-27+,31-26-,34-29+

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InChIKey: SSNZBMSHTYMPDC-ULAYHLGDSA-N

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Reference

CAS: 1283114-68-0

Properties Information

Molecule Weight: 754.1029999999995

TPSA: 168.94

MolLogP: 7.080300000000009

Number of H-Donors: 7

Number of H-Acceptors: 9

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information