U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C35H56O9
Molecular Weight 620.8137
Optical Activity ( + )
Defined Stereocenters 14 / 14
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cauloside B

SMILES

CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O

InChI

InChIKey=FCPRBNDLDDAHLC-CREXQFFGSA-N
InChI=1S/C35H56O9/c1-30(2)13-14-35(29(41)42)20(15-30)19-7-8-23-31(3)11-10-25(44-28-27(40)26(39)21(37)17-43-28)32(4,18-36)22(31)9-12-33(23,5)34(19,6)16-24(35)38/h7,20-28,36-40H,8-18H2,1-6H3,(H,41,42)/t20-,21-,22+,23+,24+,25-,26-,27+,28-,31-,32-,33+,34+,35+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
COLLINSONIN
Preferred Name English
Cauloside B
Common Name English
Caulophyllogenin 3-O-?-L-arabinopyranoside
Common Name English
Olean-12-en-28-oic acid, 3-(?-L-arabinopyranosyloxy)-16,23-dihydroxy-, (3?,4?,16?)-
Common Name English
(3?,4?,16?)-3-(?-L-Arabinopyranosyloxy)-16,23-dihydroxyolean-12-en-28-oic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
45267537
Created by admin on Mon Mar 31 20:21:29 GMT 2025 , Edited by admin on Mon Mar 31 20:21:29 GMT 2025
PRIMARY
EPA CompTox
DTXSID60925684
Created by admin on Mon Mar 31 20:21:29 GMT 2025 , Edited by admin on Mon Mar 31 20:21:29 GMT 2025
PRIMARY
FDA UNII
3DXC9E8Y5N
Created by admin on Mon Mar 31 20:21:29 GMT 2025 , Edited by admin on Mon Mar 31 20:21:29 GMT 2025
PRIMARY
CAS
12672-43-4
Created by admin on Mon Mar 31 20:21:29 GMT 2025 , Edited by admin on Mon Mar 31 20:21:29 GMT 2025
PRIMARY