ID: 98218
SMILES:c1c2c(cc(C=O)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -18.45
InChIKey:HXZOLVRQLAQLGI-UHFFFAOYSA-N
ID: 98219
SMILES:C1CC(C)=CCCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -17.427
InChIKey:XFZQUXBXYRHWRE-UHFFFAOYSA-N
ID: 98220
SMILES:OC(=O)C(C1CCC2(C)C(C1)c1c(cc(CCCCC)cc1O)O2)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -12.273
InChIKey:SQZGQZSXZHEFEB-UHFFFAOYSA-N
ID: 98221
SMILES:C(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 98222
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1(O)C(C=Cc1ccccc1)C1C(C)(C)C1C1CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.723
CB1 binding score: -16.254
InChIKey:FEYJLPUUDDNUJR-UHFFFAOYSA-N
ID: 98223
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 98224
SMILES:C(CC(=CCc1ccc(O)c(C2C(C(C)C)CCC(C)=C2)c1O)C(O)=O)(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -14.24
InChIKey:BTVOYXUDISPDIY-UHFFFAOYSA-N
ID: 98225
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 98226
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCC)c2)C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 98227
SMILES:C(C)(=C)C1C(c2c(O)cc(CCC)cc2O)C=C(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.635
InChIKey:QMLDXCYNLWFNOG-UHFFFAOYSA-N
ID: 98228
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 98229
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(O)cc2ccoc32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.355
CB1 binding score: -15.916
InChIKey:JQDKLQHPOAXGLB-UHFFFAOYSA-N
ID: 98230
SMILES:CC(O)(C)C1(O)CC(=O)C2(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3)C3CC2(CO3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -14.881
InChIKey:FRGRIQPPGDBFFX-UHFFFAOYSA-N
ID: 98231
SMILES:O=Cc1c2ccccc2c(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.404
CB1 binding score: -13.375
InChIKey:VXMUNAQHZFBWRJ-UHFFFAOYSA-N
ID: 98232
SMILES:O=C(C)OC1C(C)(C)CCCC(O)(C)C2Oc3c(c(O)cc(CCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -18.246
InChIKey:RQXVWHFMRDGVPY-UHFFFAOYSA-N
ID: 98233
SMILES:C12c3c(O)cc(C)cc3OC(CCC1C(C)(C)O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.654
InChIKey:KPCABAOYSVJJNT-UHFFFAOYSA-N
ID: 98234
SMILES:Oc1c2c(ccc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.281
InChIKey:KZTIITBECKQIPO-UHFFFAOYSA-N
ID: 98235
SMILES:CC(C1CCC(C2Oc3c(c(O)cc(CCCCC)c3)C2)=CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.617
InChIKey:GQESYYOPWBLTDS-UHFFFAOYSA-N
ID: 98236
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.929
InChIKey:HODHSCXHGRXRRQ-UHFFFAOYSA-N
ID: 98237
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 98238
SMILES:OC1C(O)C(c2c(O)cc(O)cc2CCCCC)OC(CCC=C(C)C)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -14.145
InChIKey:IJORYJICCCLFRK-UHFFFAOYSA-N