ID: 101431
SMILES:CC1(C)Oc2ccc(CCCCC)cc2C=C1CCC(=O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -12.642
InChIKey:FTAPYLXYVDYDRQ-UHFFFAOYSA-N
ID: 101432
SMILES:c1c(C2C(C(=C)C)CCC(C)=C2)c(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 101433
SMILES:c1(O)cc(C)c(O)c(CC=C(CC(OC2(C)C3CCC(C)=CC3)(C)CCC2C(=C)C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -17.426
InChIKey:RCPJWGIYIGXLQJ-UHFFFAOYSA-N
ID: 101434
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 101435
SMILES:C(=C(COC(c1ccccc1)=O)C)C1C(OC(C)=O)C(C)C=C2c3c(cc(CCCCC)cc3OC)OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.731
CB1 binding score: -12.769
InChIKey:LOXSXMRMEUKCTR-UHFFFAOYSA-N
ID: 101436
SMILES:c1(O)c(C2C(C(=C)C)C(O)CC(C)=C2)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.655
InChIKey:IPSFCQCDJHUWCV-UHFFFAOYSA-N
ID: 101437
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C(C)CCC(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.902
InChIKey:KZUOPXQDVWSGMI-UHFFFAOYSA-N
ID: 101438
SMILES:C12C3C(CC(C)C1)CCC3(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.571
InChIKey:VNMROQIVZNTBCA-UHFFFAOYSA-N
ID: 101439
SMILES:C(CCCc1ccc2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 101440
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(C)c3)C2CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.006
InChIKey:SUFPQJMELBBUPW-UHFFFAOYSA-N
ID: 101441
SMILES:c1cc2c(cc1CCCCCC)OCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.34
CB1 binding score: -13.085
InChIKey:ZCRKPWPGEJVXMU-UHFFFAOYSA-N
ID: 101442
SMILES:OC1C(=O)C2(O)C3(OCC4(C1CCCC4)C3(C)C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.078
InChIKey:ZABXCLOHNLEVKT-UHFFFAOYSA-N
ID: 101443
SMILES:C(C1=CCC2C(C)(C)Oc3cc(C)c(C4OCC(C)C4)c(O)c3C2C1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.439
InChIKey:BIOCTFGMSIRWGW-UHFFFAOYSA-N
ID: 101444
SMILES:C(=CCCC(=CCOc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1)C)CCC(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -14.922
InChIKey:YYYUKIIXIRNXME-UHFFFAOYSA-N
ID: 101445
SMILES:C(CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)C#CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.182
InChIKey:UUTLEXQGAJEZDJ-UHFFFAOYSA-N
ID: 101446
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.792
InChIKey:IEOYHNWUNCMPAY-UHFFFAOYSA-N
ID: 101447
SMILES:C(OCC1(C)C2C1c1c(cc(CCCCC)cc1O)OC(C)(CCC=C(C)C)C=C2)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.981
InChIKey:TZNLMHNMAHBXRL-UHFFFAOYSA-N
ID: 101448
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(O)C3C(=C)C21OC(C)(C)C3O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.706
InChIKey:DFANEWWNFYDCNN-UHFFFAOYSA-N
ID: 101449
SMILES:Cc1c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -17.82
InChIKey:NEECVWKINJWEIG-UHFFFAOYSA-N
ID: 101450
SMILES:C(c1cc(O)cc2c1OC(C)(C)C1C2C=C(C)CC1)#C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -14.35
InChIKey:JVMHCYVVQGZRPC-UHFFFAOYSA-N
ID: 101451
SMILES:c1(OC)cc(CCCC)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.499
InChIKey:CDCJUBPCFJBDNF-UHFFFAOYSA-N