ID: 80368
SMILES:C1CC(C(=O)CC(C)C)(C)Oc2c(c(O)cc(CCCCCC)c2)C2=C1C(O)(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -16.054
InChIKey:UCMARUGFYGIEFK-UHFFFAOYSA-N
ID: 80369
SMILES:C1(c2c(O)cc(CCCCC)cc2)C(C(CCC=C(C)C)C)CCC2(C)OC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.827
InChIKey:UKQIQWZCLLOUSZ-UHFFFAOYSA-N
ID: 80370
SMILES:CC1=CC2c3c(cc(C)c(O)c3)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 80371
SMILES:C(Cc1c(CCCC)cc2c(c1O)C1=C(C(C)(C)O2)CCC(C)=C1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.916
InChIKey:NDNNPYXWFFRIRW-UHFFFAOYSA-N
ID: 80372
SMILES:c1(CCCC)ccc(OC)c(C2C(C(C)=C)CCC(C)C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -14.578
InChIKey:IUEUYYLLYOWADV-UHFFFAOYSA-N
ID: 80373
SMILES:C1(C)(CCC=C(C)C)C=Cc2cc3c(cc2O1)OC(C)(C)C1C3C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -16.521
InChIKey:RUUPMSWCVVXVGK-UHFFFAOYSA-N
ID: 80374
SMILES:Oc1cc(CCCC)cc2c1-c1ccc(CCCCC)cc1OC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -14.522
InChIKey:ASEYNJSPBBRVDV-UHFFFAOYSA-N
ID: 80375
SMILES:C(COc1cc(CCCCC)cc(O)c1)=C(C)C=C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 260.377
CB1 binding score: -17.093
InChIKey:GFWRINTVNXWIJA-UHFFFAOYSA-N
ID: 80376
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.69
InChIKey:VZITYWYBMUXCLP-UHFFFAOYSA-N
ID: 80377
SMILES:c1(O)cc(CC=C(CCC=C(C)C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.968
InChIKey:RNKSQHRRYNTMIO-UHFFFAOYSA-N
ID: 80378
SMILES:C1=C(C)C2C(C(C)(C)Oc3c(O)c(C(C)C)cc(O)c32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -12.665
InChIKey:SUOPDZDZBSQRQT-UHFFFAOYSA-N
ID: 80379
SMILES:CC(=C)C1CCC2(C)C3(C)C4C3C(O)(OC4CC1)c1c(cc(CCC(OC(C)=O)C(=CC=O)C)cc1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.654
CB1 binding score: -17.902
InChIKey:VMWMFTRGBIFBPK-UHFFFAOYSA-N
ID: 80380
SMILES:C1=CC2C(C)(C)Oc3c(c(O)c(CCCC)c(C(O)=O)c3O)C2CC1C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -14.424
InChIKey:XCCTVQFYOWCRGD-UHFFFAOYSA-N
ID: 80381
SMILES:O(c1c2c(cc(CC(O)C(C)(O)C)c1)OC(C)(C)C1=C2CC(C)(O)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.64
InChIKey:WYXWUPYMEHURMY-UHFFFAOYSA-N
ID: 80382
SMILES:Oc1cc(C2CC(C)=CCC2C(=C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.458
InChIKey:QIRGOYAXDFPFKL-UHFFFAOYSA-N
ID: 80383
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -15.929
InChIKey:MODPLMALFJYRNR-UHFFFAOYSA-N
ID: 80384
SMILES:COc1c(O)cccc1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.334
InChIKey:KMRDHOKEJXKFMU-UHFFFAOYSA-N
ID: 80385
SMILES:C(C)(CC(c1c(O)c(C=O)c(O)c2c1OC(C)(C)C1C2CC(C)=CC1O)C1OC1(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -15.12
InChIKey:CDFPFEKZUSWUNU-UHFFFAOYSA-N
ID: 80386
SMILES:C1=C2CC(C(C)=C)CCC2(C)Oc2cc(CCC)ccc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.427
CB1 binding score: -15.632
InChIKey:VKJRIHDAXONMAE-UHFFFAOYSA-N
ID: 80387
SMILES:O1c2c(c(C)c3c(c2)C=CC(CCC=C(C)C)(C)O3)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.736
InChIKey:OGAHZTCVZUHXAV-UHFFFAOYSA-N
ID: 80388
SMILES:C1C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C=C(C(=O)O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.468
InChIKey:HZEVOPYSSUWJEV-UHFFFAOYSA-N