ID: 35176
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 35177
SMILES:C1CC(Br)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 299.208
CB1 binding score: -16.026
InChIKey:BHFVIIWKXLREML-UHFFFAOYSA-N
ID: 35178
SMILES:CCCCc1cc(O)c2c(c1)C1CC(C)=CCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.005
InChIKey:MZWCURZEOFGXNR-UHFFFAOYSA-N
ID: 35179
SMILES:Oc1c2c(cc3c(C=O)cccc13)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.404
CB1 binding score: -14.988
InChIKey:XPMNYMVMDFCTRE-UHFFFAOYSA-N
ID: 35180
SMILES:C1(C)(C)Oc2c(ccc(CCCCC)c2)C2C1CCC(C)C2OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -14.277
InChIKey:FGMDUFCJKYKTSB-UHFFFAOYSA-N
ID: 35181
SMILES:C1C=C(C)CC2C(C(C)(C)Oc3cc(C(CCCC)=O)c(O)c(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.514
InChIKey:HNDNZPPWGUHCIS-UHFFFAOYSA-N
ID: 35182
SMILES:C1(C)CCC2(C(=O)O)c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.899
InChIKey:RRKADTXDVIFXLI-UHFFFAOYSA-N
ID: 35183
SMILES:O=c1ccc2c3c(c1O)OC(C)(C)C1C3C(CCC1C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.084
InChIKey:WLGFQLPRGDDDHN-UHFFFAOYSA-N
ID: 35184
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1CCC(C)(O)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.882
InChIKey:AEEPSYRHWCXJHC-UHFFFAOYSA-N
ID: 35185
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 35186
SMILES:C12(CCC(CC(O)C=C(C(=O)O)C)(C)C1CCCO)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -17.334
InChIKey:BJCZITBGYXVPFI-UHFFFAOYSA-N
ID: 35187
SMILES:c1c(CC2CCC(CCC=C(C)C)=CCC2CO)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -18.848
InChIKey:CHPUJVNWYDTGOZ-UHFFFAOYSA-N
ID: 35188
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)c(O)c(C=O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.527
InChIKey:QXDDTBWDMMAINH-UHFFFAOYSA-N
ID: 35189
SMILES:C1=C2C(C)(C)CC(O)CC2(C)Oc2c(c(O)cc(CCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.933
InChIKey:LWAMNGQFZGAPCO-UHFFFAOYSA-N
ID: 35190
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3OC(C)=O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 35191
SMILES:C(CCC)Cc1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 35192
SMILES:OC(=O)C(C)CCCC(C)=CCCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.39
InChIKey:XVSVPDIAFSZPDZ-UHFFFAOYSA-N
ID: 35193
SMILES:C1(C(C)C)=CC(O)(C(C)=C)C(c2c(O)cc(CCCCC(O)C)cc2O)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.367
InChIKey:CSGWVYISBKJWEA-UHFFFAOYSA-N
ID: 35194
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 35195
SMILES:C(C(C)=CCc1c(O)c2c(c(CC=C(C)C)c1O)OC(C)(C)C1CCC(C)=CC21)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -14.646
InChIKey:AEJNCTHQXAPJPU-UHFFFAOYSA-N
ID: 35196
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1=C2C(O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -19.691
InChIKey:ZLYNXDIDWUWASO-UHFFFAOYSA-N