ID: 55525
SMILES:C(Cc1cc(OC)c2c(c1)OC(C)(C)C1=CCC(CO)=CC12)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.369
InChIKey:YZQSNQLFRNHISU-UHFFFAOYSA-N
ID: 55526
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=C(C(C)(C)O1)CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.377
InChIKey:RLNPBXCWDNRNHX-UHFFFAOYSA-N
ID: 55527
SMILES:c1(=O)c(-c2ccc(O)cc2CC=C(CCC=C(C)C)C)ccc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.68
CB1 binding score: -13.697
InChIKey:NSXPTIOBNMPLHT-UHFFFAOYSA-N
ID: 55528
SMILES:CC12C3C(OC1=O)c1c(cc(CCCCC)cc1O)OC3(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.721
InChIKey:BSMSINFHXNGHRF-UHFFFAOYSA-N
ID: 55529
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 55530
SMILES:c1(O)c2c(c(O)c(C(C(CC=C(C)C)C)C)c1)OC(C)(C)C1CCC(C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -12.143
InChIKey:SFXZVRVTGWVQTJ-UHFFFAOYSA-N
ID: 55531
SMILES:CC1(C)Oc2c(c3c(c(O)c2)CC2(C)C(=O)C4(O)C(C(CC)=C2C)(OC(C)(C)C(Br)C4)C3=O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 545.47
CB1 binding score: -15.519
InChIKey:CYQCCNZGIPQKMS-UHFFFAOYSA-N
ID: 55532
SMILES:C1CC2C(c3c(cc(O)c(O)c3C)OC2(C)C)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.575
InChIKey:IBASHQFKDNLDJW-UHFFFAOYSA-N
ID: 55533
SMILES:C1=CC(C)(C)C2C(C)(CC1)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.091
InChIKey:NNHBXRVBCXVRHA-UHFFFAOYSA-N
ID: 55534
SMILES:c1(CCCCC)c(C=O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -18.286
InChIKey:NQFUEDHWQJVOKZ-UHFFFAOYSA-N
ID: 55535
SMILES:C1C(C(O)(C)C)OC2C(C)(C1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.732
InChIKey:SNLWQEOGBVQFHE-UHFFFAOYSA-N
ID: 55536
SMILES:CC(CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -12.432
InChIKey:NJSRVWUCUCNOMN-UHFFFAOYSA-N
ID: 55537
SMILES:C1(C)(O)C2(C)C(C)(CCC1)Oc1c(c(OC)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.238
InChIKey:GFTVXRMXNFYSQJ-UHFFFAOYSA-N
ID: 55538
SMILES:C(C=CC(=O)O)C12C(C)(CC(=C(C)C)CC1)Oc1cc(CCCCC)c(C(=O)OC)c(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -15.751
InChIKey:GMYRSKVHWRULOH-UHFFFAOYSA-N
ID: 55539
SMILES:CCCCCc1c(C(=O)O)c(O)c2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.845
InChIKey:WWJFBPOZUKITPE-UHFFFAOYSA-N
ID: 55540
SMILES:O(C)c1c(O)c(C(=O)C(CC)C)c(OC)c2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.569
InChIKey:FYYAPZJQBKKQLD-UHFFFAOYSA-N
ID: 55541
SMILES:O(C)c1c(CC=C(C)CCC(OC)C(=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.438
InChIKey:PPLDPTLXTNVWKN-UHFFFAOYSA-N
ID: 55542
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.933
InChIKey:UTRGKQLFPFNIJR-UHFFFAOYSA-N
ID: 55543
SMILES:COc1c(O)c(C=O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.929
InChIKey:PERSBDYMDZMFSH-UHFFFAOYSA-N
ID: 55544
SMILES:C1(C)=CC2C(CC1O)C(C)(C)Oc1c(c(O)c(C(C(C(C)CC)C)=O)c(O)c1C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.293
InChIKey:KMKYNDVWIWIJPR-UHFFFAOYSA-N
ID: 55545
SMILES:C(CCC(=CCc1c(O)c(CC=C(C)C)c(O)c(O)c1)C(=C)C)(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.796
InChIKey:XNMJUKZPFRMHRN-UHFFFAOYSA-N