Kajiichigoside F1
CAS Registry Number®
95298-47-8
CAS Name
Kajiichigoside F1Molecular Formula
C36H58O10Molecular Mass
650.84Cite this Page
Kajiichigoside F1. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=95298-47-8 (retrieved ) (CAS RN: 95298-47-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
230-232 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C36H58O10/c1-18-10-13-36(30(43)46-29-26(41)25(40)24(39)21(17-37)45-29)15-14-33(5)19(27(36)35(18,7)44)8-9-23-32(4)16-20(38)28(42)31(2,3)22(32)11-12-34(23,33)6/h8,18,20-29,37-42,44H,9-17H2,1-7H3/t18-,20-,21-,22+,23-,24-,25+,26-,27-,28-,29+,32+,33-,34-,35-,36+/m1/s1
InChIKey
InChIKey=MLKQAGPAYHTNQQ-FUZXVMJXSA-N
SMILES
C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)(=O)[C@]23[C@](C=4[C@@](C)(CC2)[C@@]5(C)[C@](CC4)([C@]6(C)[C@@](CC5)(C(C)(C)[C@H](O)[C@H](O)C6)[H])[H])([C@](C)(O)[C@H](C)CC3)[H]
Canonical SMILES
O=C(OC1OC(CO)C(O)C(O)C1O)C23CCC(C)C(O)(C)C3C4=CCC5C6(C)CC(O)C(O)C(C)(C)C6CCC5(C)C4(C)CC2
Other Names for this Substance
- Urs-12-en-28-oic acid, 2,3,19-trihydroxy-, β-D-glucopyranosyl ester, (2α,3α)-
- Kajiichigoside F1
- 2α,3α,19α-Trihydroxylurs-12-en-28-oic acid-28-O-β-D-glucopyranoside
- 2α,3α,19α-Trihydroxyurs-12-en-28-oic acid ester glucoside
- Euscaphic acid 28-O-β-D-glucopyranoside
Deleted or Replaced CAS Registry Numbers
1498308-59-0