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Alpha-amyrin

Family: Plantae - Rubiaceae
Kingdom: Plantae
Class: Terpenoid
- Subclass: Triterpenoid

Canonical Smiles	C[C@@H]1CC[C@]2([C@@H]([C@H]1C)C1=CC[C@H]3[C@@]([C@@]1(CC2)C)(C)CC[C@@H]1[C@]3(C)CC[C@@H](C1(C)C)O)C
InChI	InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h9,19-20,22-25,31H,10-18H2,1-8H3/t19-,20+,22+,23-,24+,25+,27-,28+,29-,30-/m1/s1
InChIKey	FSLPMRQHCOLESF-SFMCKYFRSA-N
Formula	C₃₀H₅₀O
HBA	1
HBD	1
MW	426.73
Rotatable Bonds	0
TPSA	20.23
LogP	8.02
Number Rings	5
Number Aromatic Rings	0
Heavy Atom Count	31
Formal Charge	0
Fraction CSP3	0.93
Exact Mass	426.39
Number of Lipinski Rule Violations	1

#	Species	Family	Kingdom	NCBI Taxonomy ID
1	Pergularia tomentosa	Apocynaceae	Plantae	264979
2	Periploca laevigata	Apocynaceae	Plantae	413294
3	Solenostemma argel	Apocynaceae	Plantae	219273
4	Bombax malabaricum	Bombacaceae	Plantae	45325
5	Cleome paradoxa	Capparaceae	Plantae	2650045
6	Torilis radiata	Apiaceae	Plantae	40890
7	Centaurea africana	Asteraceae	Plantae	2950952
8	Echinops galalensis	Asteraceae	Plantae	32194
9	Gaillardia aristata	Asteraceae	Plantae	55624
10	Inula crithmoides	Asteraceae	Plantae	119182
11	Boswellia neglecta	Burseraceae	Plantae	246345
12	Commiphora confusa	Burseraceae	Plantae	43868
13	Boswellia species	Burseraceae	Plantae	173701
14	Vernonia auriculifera	Asteraceae	Plantae	3032568
15	Vernonia auriculifera	Asteraceae	Plantae	3032568
16	Artocarpus communis	Moraceae	Plantae	194251
17	Sarcocephalus pobeguinii	Rubiaceae	Plantae	170073

Showing of synonyms

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