ID: 85597
SMILES:C1C(C(C)(O)CCC=C(C)C)c2c(c(C(O)=O)c(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.084
InChIKey:VTIDMBAEICKIAK-UHFFFAOYSA-N
ID: 85598
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C=O)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 85599
SMILES:C1(C)(C)Oc2c(cc(O)cc2CCCCC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -16.229
InChIKey:ITEAYSXDMPHSRQ-UHFFFAOYSA-N
ID: 85600
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1CC(C)=CCC1(O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.249
InChIKey:ZRPIIKPHNBTQOC-UHFFFAOYSA-N
ID: 85601
SMILES:c12c(c(O)cc(C)c1)C1C(CCC(C)=C1)C(C)(C(C(C(C)=C)O)=O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.356
InChIKey:YUPJLLWOXSIPLS-UHFFFAOYSA-N
ID: 85602
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 85603
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(CO)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.27
InChIKey:MOZCGGVNNGJCQJ-UHFFFAOYSA-N
ID: 85604
SMILES:C12(C)CCC(c3c(O)cc(CCC)cc3O)(C)C1CC=C(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -12.489
InChIKey:AMVJYJMXLWBGLL-UHFFFAOYSA-N
ID: 85605
SMILES:CC1(C)C2CCC(=C)CC2c2c(c(C(C)C)ccc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.431
InChIKey:ZQKOSJASWJBEMC-UHFFFAOYSA-N
ID: 85606
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCCC)cc31)CC(C)=CC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.388
InChIKey:XWSHHGKTBMJIRT-UHFFFAOYSA-N
ID: 85607
SMILES:c1(OC(=O)C(C)C)c2c(cc(CCCCC)c1)OC(C(C)(O)C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -14.903
InChIKey:LFXKEHXGCICYGQ-UHFFFAOYSA-N
ID: 85608
SMILES:COC(=O)C12c3c(cc(CCCCC)cc3O)OC(C)(C)C3C1C(C)(C(O)C3)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -14.716
InChIKey:GYZJRZXRNYLLSW-UHFFFAOYSA-N
ID: 85609
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(CO)C(O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 85610
SMILES:C1=CC(C)(O)C(CCC(C)=CCc2cc(O)cc(C)c2O)(C)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.129
InChIKey:LKJHIWBXWZVCRP-UHFFFAOYSA-N
ID: 85611
SMILES:C(OC)(=O)C1=CCCC2C3C1c1c(O)cc(CCC)cc1OC3(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.153
InChIKey:LYPJAYGESIXBIN-UHFFFAOYSA-N
ID: 85612
SMILES:C(C)(CC(O)=O)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.502
InChIKey:OEVPNXGLYNXFNJ-UHFFFAOYSA-N
ID: 85613
SMILES:OC1C(O)C(O)C(CO)OC1OCC1(O)CCC=C(C)Cc2c(O)ccc(c2)Oc2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.666
CB1 binding score: -15.929
InChIKey:UFQNNUZTWKLNEM-UHFFFAOYSA-N
ID: 85614
SMILES:CC(O)(C)C(C(O)CC1(C)C(C)c2c(c3c(cc(CCCCC)cc3O)OC2(C)C)CC1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.654
CB1 binding score: -12.087
InChIKey:MILWXIKRIHLHOF-UHFFFAOYSA-N
ID: 85615
SMILES:C(C(c1c(C=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C(O)CO)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -15.611
InChIKey:AIFIXNBSDDUWGU-UHFFFAOYSA-N
ID: 85616
SMILES:CC(=O)CCCC(C)(C1C2C(C)(CC1)Oc1cc(CCCCC)cc(O)c12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.361
InChIKey:LKTOEOLSBUJQQH-UHFFFAOYSA-N
ID: 85617
SMILES:CC1C2CCC(C=O)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.251
InChIKey:ZIOXFXGZIRFBHR-UHFFFAOYSA-N