(Q27139233)

Protoprimulagenin A (English)

(1S,2R,4S,5R,8R,10S,13S,14R,17S,18R)-4,5,9,9,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-2,10-diol

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₃₀H₅₀O₃

1 reference

Protoprimulagenin A (English)

7 October 2016

canonical SMILES

CC1(CCC23COC4(C2C1)CCC5C6(CCC(C(C6CCC5(C4(CC3O)C)C)(C)C)O)C)C

1 reference

Protoprimulagenin A (English)

7 October 2016

isomeric SMILES

C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC[C@@]45[C@]3(C[C@H]([C@@]6([C@H]4CC(CC6)(C)C)CO5)O)C)C)(C)C)O

1 reference

Protoprimulagenin A (English)

7 October 2016

found in taxon

Aegiceras corniculatum

1 reference

Oleanane triterpenes from Aegiceras corniculatum

Embelia schimperi

3 references

Pentacyclic triterpenoids from Embelia schimperi

Pentacyclic triterpenoids from Embelia schimperi

Oleanane-type triterpenes of Embelia schimperi leaves

Clavija procera

1 reference

Aegicerin, the first oleanane triterpene with wide-ranging antimycobacterial activity, isolated from Clavija procera

Identifiers

InChI

InChI=1S/C30H50O3/c1-24(2)14-15-29-18-33-30(21(29)16-24)13-9-20-26(5)11-10-22(31)25(3,4)19(26)8-12-27(20,6)28(30,7)17-23(29)32/h19-23,31-32H,8-18H2,1-7H3/t19-,20+,21+,22-,23+,26-,27+,28-,29+,30-/m0/s1

1 reference

Protoprimulagenin A (English)

LFBHIAAGGTTWAT-DNSXXVLGSA-N

7 October 2016

InChIKey

2 references

Protoprimulagenin A (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

(3beta,16alpha)-13,28-Epoxyoleanane-3,16-diol (English)

7 October 2016

1 reference

Protoprimulagenin A (English)

7 October 2016

ChEBI ID

70987

mapping relation type

1 reference

(3beta,16alpha)-13,28-epoxyoleanane-3,16-diol (English)

7 October 2016

1 reference