ID: 69952
SMILES:Oc1cc(CCCCC)cc(O)c1C1C(C(=C)C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 69953
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 69954
SMILES:C1(C)=CCCC(C)(C)C2C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.368
InChIKey:JWKOXBDMVLVFNH-UHFFFAOYSA-N
ID: 69955
SMILES:C1(O)=C2OC(C)(C)C3CCC(C)C(C23)C1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 238.327
CB1 binding score: -17.838
InChIKey:ZFWCNUYPMJPPPF-UHFFFAOYSA-N
ID: 69956
SMILES:C(CC)(CCC)C(c1c2c(cc(O)c1C)OC(CCC=C(C)C)(C)C=C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -17.901
InChIKey:YAFQAJKJDMTNNK-UHFFFAOYSA-N
ID: 69957
SMILES:O1C2(C)C1C1C(C(C)(C)Oc3c1c(O)cc(CCCCC)c3)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.749
InChIKey:GPTDNUGRWJWKLF-UHFFFAOYSA-N
ID: 69958
SMILES:c1(OC)c(CCCC)cc2c(c1O)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.745
InChIKey:LTDLIWCHEKTWCV-UHFFFAOYSA-N
ID: 69959
SMILES:C(CC=O)Cc1cc2c(c(O)c1)C1C(CCC(=C)C2O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.621
InChIKey:SKEHECAROOUYMR-UHFFFAOYSA-N
ID: 69960
SMILES:Oc1c(C=C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -16.351
InChIKey:LLCSRLGHWHTJJX-UHFFFAOYSA-N
ID: 69961
SMILES:C1(=O)C(C)(CCC=C(C)C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.104
InChIKey:RUSNJCCUCAUYFM-UHFFFAOYSA-N
ID: 69962
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 69963
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(c(O)cc(CCCCC)c1)CC2(C)C=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -13.459
InChIKey:ZMSALUGTRLAAJZ-UHFFFAOYSA-N
ID: 69964
SMILES:Oc1c2c(cc(CCC)c1)OC(c1c(O)cc(O)cc1)C(CCC(C(O)=O)CCCC(=C)C)(C)C(OC)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.67
CB1 binding score: -14.766
InChIKey:ABOUCYJWDTXSQB-UHFFFAOYSA-N
ID: 69965
SMILES:C1(C)(O)C2(CC1)C(C)(C)Oc1cc(CCCCCO)c(OC)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -12.478
InChIKey:LOAMIKMDWRDETI-UHFFFAOYSA-N
ID: 69966
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 69967
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(OC)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.024
InChIKey:MVRKTZAGCVMDGH-UHFFFAOYSA-N
ID: 69968
SMILES:c1(CCCCCC)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c(C(=O)CCc2ccccc2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.658
CB1 binding score: -14.356
InChIKey:YFAMDNZFHXENHW-UHFFFAOYSA-N
ID: 69969
SMILES:O1C(CO)C(O)C(O)C1Oc1c(O)cc(CCCCC)cc1C1C=C(C)CCC1=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.994
InChIKey:PLLDKNPRZLUAID-UHFFFAOYSA-N
ID: 69970
SMILES:C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(=O)C(C)(O)C(OC(C(C)=CC)=O)C1O)(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.588
CB1 binding score: -13.428
InChIKey:YFVPQGLSNNHUBB-UHFFFAOYSA-N
ID: 69971
SMILES:C(OC)Cc1ccc(O)c2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.305
InChIKey:OCUIJICDJLGMNF-UHFFFAOYSA-N
ID: 69972
SMILES:COc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.5
InChIKey:RPLKKIAMEMEPBV-UHFFFAOYSA-N