ID: 95131
SMILES:c1c(O)c2c3c(c1-c1c(O)cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)(CC13)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.564
CB1 binding score: -15.011
InChIKey:UEYOIBCFCDGESE-UHFFFAOYSA-N
ID: 95132
SMILES:C1C(C)(C)C2=C(c3c(cc(CCCCC)cc3O)O1)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -10.947
InChIKey:BVARDKUSHKJMIP-UHFFFAOYSA-N
ID: 95133
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 95134
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C(=O)O)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -18.309
InChIKey:KYBSQVMEBKBMOK-UHFFFAOYSA-N
ID: 95135
SMILES:C=C(C1CCC2(CO)C(C(c3c(O)cc(CCCCC)cc3OC)O2)O1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.285
InChIKey:YNUDUEVKUOIKNC-UHFFFAOYSA-N
ID: 95136
SMILES:CC1(C)C2(C(=C)CC1O)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.502
InChIKey:JNDHZCJCWVMDKG-UHFFFAOYSA-N
ID: 95137
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 95138
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 95139
SMILES:CC(C)(C1C(c2c(O)cc(CCCCC)cc2OC)CC(C)=CC1=O)NCCN
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.579
CB1 binding score: -15.313
InChIKey:RCAVOFHHMJZBNP-UHFFFAOYSA-N
ID: 95140
SMILES:C1CCC(CN(C)C(C(=O)OC2C(C)(CCC=C(C)C)Oc3c(c(OC)cc(CCCCC)c3)C2)C)C2(C)CC1C=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 593.893
CB1 binding score: -16.229
InChIKey:YYKNCODPFOXGEA-UHFFFAOYSA-N
ID: 95141
SMILES:C1(O)(C)C2Oc3c(c(O)cc(CCCCC)c3)C(O)(C1C=C(C)C)CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.511
InChIKey:UOCOPLSQFXSMSO-UHFFFAOYSA-N
ID: 95142
SMILES:O[N+](=O)c1c2c(c(O)c(-c3ccc(O)cc3)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.436
CB1 binding score: -16.571
InChIKey:QQIQBGMSWBEZIF-UHFFFAOYSA-O
ID: 95143
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 95144
SMILES:C(CCc1ccc2c(c1C)C1C=C(C)CCC1C(C)(C)O2)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -17.069
InChIKey:WDPFTXOSUSNOJF-UHFFFAOYSA-N
ID: 95145
SMILES:O1c2c(cc(O)c(=O)c(C)c2)C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.094
InChIKey:PYCZZUOXJLPIBU-UHFFFAOYSA-N
ID: 95146
SMILES:c1(COC(=O)C(C)=CC)cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -13.211
InChIKey:NKIKFHCQERNZFJ-UHFFFAOYSA-N
ID: 95147
SMILES:C1(C)=CCCC(C)=CCCC(C=O)=CCc2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -16.74
InChIKey:JIUVONFHTWBQOD-UHFFFAOYSA-N
ID: 95148
SMILES:C1CC(C)=CCC2(C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.125
InChIKey:BXEBSNTVOHKPCX-UHFFFAOYSA-N
ID: 95149
SMILES:Oc1c2c(cc(CCCCCCCC)c1)OC(CCC=C(C)C)(C)C1C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.683
CB1 binding score: -15.119
InChIKey:XQWPPSGXIIBAOO-UHFFFAOYSA-N
ID: 95150
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 95151
SMILES:C1C2(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.388
InChIKey:RKXZJLJFMSUGNO-UHFFFAOYSA-N