138682-08-3

AlkaPlorer ID: AK046798

Synonym: None

IUPAC Name: (2S,3R)-2-[[(2S)-4-amino-2-[[(3R)-3-hydroxydodecanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxy-N-(4-methyl-1-oxopentan-2-yl)pentanediamide

Structure

SMILES: CCCCCCCCC[C@@H](O)CC(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)NC(C=O)CC(C)C)[C@H](O)CC(N)=O

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InChI: InChI=1S/C27H49N5O8/c1-4-5-6-7-8-9-10-11-19(34)13-24(38)31-20(14-22(28)36)26(39)32-25(21(35)15-23(29)37)27(40)30-18(16-33)12-17(2)3/h16-21,25,34-35H,4-15H2,1-3H3,(H2,28,36)(H2,29,37)(H,30,40)(H,31,38)(H,32,39)/t18?,19-,20+,21-,25+/m1/s1

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InChIKey: DHYUJQKWCJOPLE-GSZDTLHVSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Penicillium dierckxii Penicillium Aspergillaceae Eurotiales Eurotiomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 571.7160000000001

TPSA: 231.01

MolLogP: -0.3107999999999921

Number of H-Donors: 7

Number of H-Acceptors: 8

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information