ID: 91414
SMILES:O1c2cc(CCCCC)cc(O)c2C(C(C)C)CC2C(O)(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.125
InChIKey:KWMRPWZHAWBCAE-UHFFFAOYSA-N
ID: 91415
SMILES:CC1=CC2C(C(C)(C)Oc3c(C)cc(OC)cc32)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.503
InChIKey:CYHVQUFVSRRRGI-UHFFFAOYSA-N
ID: 91416
SMILES:C12C(C)(C)CC3(c4c(cc(CCCCC)cc4O)O3)C(=C1)CC(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.609
InChIKey:PZCLYFATKMEYQW-UHFFFAOYSA-N
ID: 91417
SMILES:O(C)c1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.724
InChIKey:QBBSJJTZVDSQMY-UHFFFAOYSA-N
ID: 91418
SMILES:CCCCCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 91419
SMILES:C(C)(CCC=C(C)C)=CCc1c(OC(C)=O)cc(C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.332
InChIKey:HAXRQCRJABYNJC-UHFFFAOYSA-N
ID: 91420
SMILES:Oc1c2c(cc(CCC)c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -17.005
InChIKey:AXJOEUXJCVCGPB-UHFFFAOYSA-N
ID: 91421
SMILES:C(CCC(O)=O)Cc1cc(O)c(C2C(C(=C)C)CCC(=C)C2)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.112
InChIKey:LRRQOGNTKXSNBJ-UHFFFAOYSA-N
ID: 91422
SMILES:c1(O)cc(C(O)C(C)CC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.412
InChIKey:FXWYBJLHVSYFDS-UHFFFAOYSA-N
ID: 91423
SMILES:C(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.483
InChIKey:NOBVLNKOMCEFJL-UHFFFAOYSA-N
ID: 91424
SMILES:C(CCC)Cc1cc(O)c(C(CC=C(C)C)=O)c(OC2C(O)C(O)C(O)C(COC(=O)C)O2)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.554
CB1 binding score: -15.784
InChIKey:OCRDXWOGZMXHIE-UHFFFAOYSA-N
ID: 91425
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.51
InChIKey:LVQZQKXEEYFSQO-UHFFFAOYSA-N
ID: 91426
SMILES:C(C=C)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.957
InChIKey:MTBKFELEBUQONK-UHFFFAOYSA-N
ID: 91427
SMILES:C(C1(C)C(c2c(O)cc(CCCCC)cc2O)OC(C(C)=C)CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -13.672
InChIKey:TYJRHOVXRDDNJY-UHFFFAOYSA-N
ID: 91428
SMILES:C1C2=C(c3c(cc(CCCCC)cc3O)O1)CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.434
InChIKey:SIVIFRYDHQURLF-UHFFFAOYSA-N
ID: 91429
SMILES:C1(C(=O)O)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -18.209
InChIKey:RAWHNNKBKXBZJY-UHFFFAOYSA-N
ID: 91430
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 91431
SMILES:C(CCC)c1cc2c(c(O)c1)C1C(C(C)(O)C)(O2)C=C2OC(C)(C)C3OC(C)(C)C4C3C=C(C)CC(O)C4(C2C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.751
CB1 binding score: -16.332
InChIKey:IUCWAEBYHSWLEG-UHFFFAOYSA-N
ID: 91432
SMILES:C1=Cc2c(cc(C(O)=O)cc2CCCCC)OC1(CC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.908
InChIKey:HHBAKAFTHGAMKD-UHFFFAOYSA-N
ID: 91433
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)(N=[N+]=S)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 331.461
CB1 binding score: -14.585
InChIKey:LBQBXAJBDXIYQK-UHFFFAOYSA-O
ID: 91434
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N