(Q105273741)

English

(1R,3S,4R,5S,7R,9S,12R,14S,17R,18R,19R,21R,22R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-5,9-diol

chemical compound

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instance of

type of chemical entity

0 references

subclass of

22-(2-Hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-5,9-diol

1 reference

based on heuristic

inferred from SMILES

mass

488.350174636 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,3S,4S,5S,7R,9S,12R,14S,17R,18R,19R,21R,22S)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-5,9-diol

1 reference

based on heuristic

inferred from InChIKey

chemical formula

C₃₀H₄₈O₅

0 references

canonical SMILES

OC1CC2C(C)(C)C(O)CCC32CC43CCC5(C)C6C(C)CC7OC6(OC7C(O)(C)C)CC5(C)C14

0 references

isomeric SMILES

C[C@@H]1C[C@H]2O[C@]3(C[C@@]4(C)[C@H]5[C@@H](O)C[C@H]6C(C)(C)[C@@H](O)CC[C@@]67C[C@@]57CC[C@]4(C)[C@@H]13)O[C@H]2C(C)(C)O

0 references

found in taxon

Astragalus orbiculatus

1 reference

stated in

Triterpene glycosides ofAstragalus and their genins. XXII. Cycloorbicoside A fromAstragalus orbiculatus

Identifiers

InChI

InChI=1S/C30H48O5/c1-16-12-18-23(25(4,5)33)35-30(34-18)14-27(7)22-17(31)13-19-24(2,3)20(32)8-9-28(19)15-29(22,28)11-10-26(27,6)21(16)30/h16-23,31-33H,8-15H2,1-7H3/t16-,17+,18-,19+,20+,21-,22-,23-,26-,27+,28-,29+,30-/m1/s1

0 references

InChIKey

UIYLAWWWFYWOAN-ZDIAFKDISA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UIYLAWWWFYWOAN-ZDIAFKDISA-N

(Q105273741)

(1R,3S,4R,5S,7R,9S,12R,14S,17R,18R,19R,21R,22R)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.01,18.03,17.04,14.07,12.012,14]tetracosane-5,9-diol

Statements

Identifiers

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