Nh2-e-d-v-v-abu-y-s-abu-s-y-oh

Structural Information

Molecular Formula

C₅₁H₇₄N₁₀O₁₉

SMILES

CCC(C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)C(CC)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)N

InChI

InChI=1S/C51H74N10O19/c1-7-31(44(72)58-37(23-63)48(76)57-35(51(79)80)20-27-11-15-29(65)16-12-27)53-47(75)36(22-62)59-45(73)33(19-26-9-13-28(64)14-10-26)56-43(71)32(8-2)54-49(77)40(24(3)4)61-50(78)41(25(5)6)60-46(74)34(21-39(68)69)55-42(70)30(52)17-18-38(66)67/h9-16,24-25,30-37,40-41,62-65H,7-8,17-23,52H2,1-6H3,(H,53,75)(H,54,77)(H,55,70)(H,56,71)(H,57,76)(H,58,72)(H,59,73)(H,60,74)(H,61,78)(H,66,67)(H,68,69)(H,79,80)/t30-,31?,32?,33-,34-,35-,36-,37-,40-,41-/m0/s1

InChIKey

OSTDYMRPPXNQTM-QXVLSWODSA-N

Compound name

(4S)-4-amino-5-[[(2S)-3-carboxy-1-[[(2S)-1-[[(2S)-1-[[1-[[(2S)-1-[[(2S)-1-[[1-[[(2S)-1-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 492368