ID: 46747
SMILES:OC(C)(c1c(O)cc2c(c1)OC(C)(C)C1CCC(O)(C)C1C2)C=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.303
InChIKey:IONJBTSCBACGDM-UHFFFAOYSA-N
ID: 46748
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1C=C(C)C(=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 46749
SMILES:CC1=CC2c3c(cc(C)cc3OC)OC1(C)CC2C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.59
InChIKey:JUQQZWXLIUBONC-UHFFFAOYSA-N
ID: 46750
SMILES:Oc1cc(CCCCC)cc(O)c1C1C=C(C(OC)=O)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.286
InChIKey:CFAWMAWNLAOICA-UHFFFAOYSA-N
ID: 46751
SMILES:c1(OC(=O)C)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.019
InChIKey:ITBNYYURUVKIDU-UHFFFAOYSA-N
ID: 46752
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=CCC3C(C)(C)CCC(O)C3(C)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.756
InChIKey:KSHFNZVWJGSUPD-UHFFFAOYSA-N
ID: 46753
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46754
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 344.495
CB1 binding score: -18.333
InChIKey:VBDIXNLNHNEWSQ-UHFFFAOYSA-N
ID: 46755
SMILES:CC(C)(C=CCC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.072
InChIKey:YAWMQNMHJJPAGB-UHFFFAOYSA-N
ID: 46756
SMILES:CSc1c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.564
CB1 binding score: -16.193
InChIKey:LEVVJTSPOYSFOI-UHFFFAOYSA-N
ID: 46757
SMILES:O1c2c(ccc(CCCC(C)=O)c2)CCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -14.827
InChIKey:PFWCERJZFJTXHI-UHFFFAOYSA-N
ID: 46758
SMILES:O=C(C=C(C)C)CC(C)=CCCC(=CCC1CC(C)=CC(c2c(O)cc(O)cc2O)CC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.143
InChIKey:UHEUXYQUCJKBKU-UHFFFAOYSA-N
ID: 46759
SMILES:c1(C=O)c(CCCCC)cc2c(c1O)-c1c(ccc(C)c1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -13.602
InChIKey:MWTJSAORIZSVDP-UHFFFAOYSA-N
ID: 46760
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 46761
SMILES:CC1(C)C2CC(C(C)(O)C=C)c3c(cc(CCCCC)cc3O)OC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.706
InChIKey:CIIOVPGIRUZDAB-UHFFFAOYSA-N
ID: 46762
SMILES:Oc1c(O)c(C(C(CC)=O)C)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.889
InChIKey:RKNAYYBDWWOHQC-UHFFFAOYSA-N
ID: 46763
SMILES:CC1=C2C(=C(C)CC2)c2c(cc(CCCCC)c(C(=O)O)c2O)OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.683
InChIKey:SSXJXUHZKDZUEV-UHFFFAOYSA-N
ID: 46764
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(=C)C1)(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.849
InChIKey:JUJZOUXZKSVEGG-UHFFFAOYSA-N
ID: 46765
SMILES:CC12C3C(C(=C)C)CC4C3(C(OC1=O)O4)c1c(O)cc(C)cc1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.364
CB1 binding score: -15.648
InChIKey:WKZFSOYXWLDYMC-UHFFFAOYSA-N
ID: 46766
SMILES:C1CC2=CC(c3c(O)cc(CCCCC)cc3O)OC(C=C(C)C)C(O)C2(C)OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -16.229
InChIKey:QTSJASPFBAKZBV-UHFFFAOYSA-N
ID: 46767
SMILES:O(Cc1c2c(cc(C)c1C1CC(C)=CC(=O)O1)OC(C)(C)C1C2C=C(C)CC1)C(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -15.399
InChIKey:DOLOZSTYXFSJRX-UHFFFAOYSA-N