ID: 108277
SMILES:C(CCC)c1cc(O)c2c(c1C=O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.14
InChIKey:VKGZBUWZLBUHMD-UHFFFAOYSA-N
ID: 108278
SMILES:C1(C)COc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.416
InChIKey:IJAURKYCKBNKSR-UHFFFAOYSA-N
ID: 108279
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(=C(C=O)C)C(C=C)(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.571
InChIKey:HSLUYYSHULZWHZ-UHFFFAOYSA-N
ID: 108280
SMILES:C(C=C(CCC=C(C)C)C)c1c(O)cc(CCCCC)cc1OC(=O)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.387
InChIKey:SBNORMJDPQVUMD-UHFFFAOYSA-N
ID: 108281
SMILES:C(Cc1c2c(ccc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12)CC(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.851
InChIKey:KCNXABXMQSEUNI-UHFFFAOYSA-N
ID: 108282
SMILES:C1C2C(C(=O)c3cc(O)c(C)cc3OC2(C)C)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.767
InChIKey:VCXNHORFFDOIRL-UHFFFAOYSA-N
ID: 108283
SMILES:C(OC)c1c2c(ccc1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -13.676
InChIKey:TXMIPZZDIAFEKN-UHFFFAOYSA-N
ID: 108284
SMILES:C(CC)CCc1cc(O)c(C2C=C(C)C(O)CC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.628
InChIKey:IERRHQRZTSKZCS-UHFFFAOYSA-N
ID: 108285
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C(=C)C)(O2)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.358
InChIKey:QYGPIWNYJQUJPH-UHFFFAOYSA-N
ID: 108286
SMILES:OC1C(C)=CC2c3c(cc(C)cc3OC)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.845
InChIKey:NTZRDMBPZXEKDU-UHFFFAOYSA-N
ID: 108287
SMILES:CC1(C)CC2=C(C(OO)c3c(cc(CCCCC)cc3O)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.502
InChIKey:IZAGQDLTZITAFM-UHFFFAOYSA-N
ID: 108288
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.309
InChIKey:KQWJMEAIWXADAY-UHFFFAOYSA-N
ID: 108289
SMILES:O=c1c2c(c(CCC)cc(O)c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -14.416
InChIKey:YRIGNGNEXOXBRQ-UHFFFAOYSA-N
ID: 108290
SMILES:C(C=C(C)C)c1c(OC2OC(C)C(O)C(O)C2O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.508
CB1 binding score: -16.784
InChIKey:FVVXLERDRFYNAF-UHFFFAOYSA-N
ID: 108291
SMILES:CC(=CC1Oc2cc(CCCCC)cc(OC)c2C2C=C(C)CC3C12C(C)CCC3C(C)CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.853
CB1 binding score: -12.977
InChIKey:TWLOZMPXODEFBU-UHFFFAOYSA-N
ID: 108292
SMILES:CCCCCc1cc(O)c(C2C=C(C)CC(c3c(CC[N+](C)(O)C)cc(O)cc3)(O)C(CC=C(C)C)C2=O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.76
CB1 binding score: -15.058
InChIKey:CDKLJDFWMLNWNW-UHFFFAOYSA-O
ID: 108293
SMILES:O=C1C=C(C)CC2C1C(C)(C)Oc1cc(O)cc(C)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.545
InChIKey:SFQALSMFMHKNDQ-UHFFFAOYSA-N
ID: 108294
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.943
InChIKey:KYRROFIRFUYHRQ-UHFFFAOYSA-N
ID: 108295
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 108296
SMILES:O1C(C)(C)C=Cc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.934
InChIKey:SIKFDXUFVYCZGK-UHFFFAOYSA-N
ID: 108297
SMILES:CC(=C1C2CC(C)(Oc3cc(CCCCC)cc4c3C(CCC4(C)O)C(O)=C2)O1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.084
InChIKey:PRBMGWHOLFVYLS-UHFFFAOYSA-N