ID: 31165
SMILES:Oc1cc(C)cc(O)c1C1OC(C)(CCC=C(C)C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -15.6
InChIKey:XKORVDBAFISNNC-UHFFFAOYSA-N
ID: 31166
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)C3C(C1CC2(C)C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.279
InChIKey:JEBSJPDMDHTZFU-UHFFFAOYSA-N
ID: 31167
SMILES:c1(OC)c(OC(=O)C)c2c(c(C(CCC(C)=C)O)c1)OC(C)(C)C1CC=C(COC(=O)C(C)=CC)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.643
CB1 binding score: -15.34
InChIKey:RBEXGBIMWRMOCZ-UHFFFAOYSA-N
ID: 31168
SMILES:COC(=O)C1(C)CC2c3c(cc(CCCCC)cc3O)OC3(C)CCC(C(C)CC1OC(=O)C)C32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -13.886
InChIKey:MAFXFFWPSOTWFS-UHFFFAOYSA-N
ID: 31169
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C)(CCC1C(=C)C)O2)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.742
InChIKey:BVLGLLUKZBVKLN-UHFFFAOYSA-N
ID: 31170
SMILES:C(=Cc1c(O)c2c(cc1O)OC(C)(C)C1C2CC(C)=CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.792
InChIKey:JYVMIUNIMCIDQQ-UHFFFAOYSA-N
ID: 31171
SMILES:Oc1c2c(cc(CCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -19.121
InChIKey:CVXVLENENUQXCN-UHFFFAOYSA-N
ID: 31172
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C2C(C)(CC1)O2)(C(OC)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -13.889
InChIKey:LDICOQXNEUXLGR-UHFFFAOYSA-N
ID: 31173
SMILES:C(C(C)O)Oc1cc(OC)c2c(c1)C1C(C(C)(C)O2)CCC(=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.321
InChIKey:MJJMKKIUZZRJHC-UHFFFAOYSA-N
ID: 31174
SMILES:C(CCC)Oc1cc2c(c3c1CC3(C)O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.119
InChIKey:KFQPQHAOUQBTRO-UHFFFAOYSA-N
ID: 31175
SMILES:C1C(O)C(C)=CC2C1C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 274.36
CB1 binding score: -17.694
InChIKey:KDZKTWRIFRUSPJ-UHFFFAOYSA-N
ID: 31176
SMILES:C1(O)C(C)=CC2c3c(CCCCCC)cc(cc3O)OC1(C(=C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.808
InChIKey:MUOQTDHDCAJUEG-UHFFFAOYSA-N
ID: 31177
SMILES:C12(c3c(cc(CCCCC)cc3O)O1)OC1(C(C)CCC(C(C)C)C1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.033
InChIKey:DSKGXNZVSJRVCV-UHFFFAOYSA-N
ID: 31178
SMILES:c1(C(CCO)C)cc(CCCCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.935
InChIKey:LUEZJGWBCQSUMW-UHFFFAOYSA-N
ID: 31179
SMILES:C1(C)=C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.471
InChIKey:XIJFCFLCUJWJTN-UHFFFAOYSA-N
ID: 31180
SMILES:C(=CCc1cc(OC)cc(C)c1O)(CCC=C(C)C=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.271
InChIKey:LTUYWLMIHKGWJM-UHFFFAOYSA-N
ID: 31181
SMILES:c1(O)cc(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: 31182
SMILES:O=C(C)c1c(CCCCC)cc(O)c2c1OC(C)(C)C1C2CC(O)C1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: Not available
InChIKey:WVTBYWCQPVUYHD-UHFFFAOYSA-N
ID: 31183
SMILES:C1CC(C)C2=C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C2CC(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.043
InChIKey:AQNSEQSRFBKSJL-UHFFFAOYSA-N
ID: 31184
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)C21)CC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -12.915
InChIKey:BRPLGQOBNGIOHV-UHFFFAOYSA-N
ID: 31185
SMILES:c1(O)c(CC(OC)=O)cc(OC)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.784
InChIKey:NOZPQCATZMJRTD-UHFFFAOYSA-N