ID: 71212
SMILES:OC(C12c3c(cc(CCCCC)cc3O)OC3(C)C(O3)C1O2)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.341
CB1 binding score: -14.626
InChIKey:NKJLIPSSAHMRNS-UHFFFAOYSA-N
ID: 71213
SMILES:C(C)(C1CC(O)C(C)=CC1c1c(CCCCC)cc(O)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.645
InChIKey:QFBGUBAPLYNEFJ-UHFFFAOYSA-N
ID: 71214
SMILES:C1(O)CC(O)C2(C)OC2CC12C(C)Cc1c2c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.627
InChIKey:UYZADOBDDGVLCH-UHFFFAOYSA-N
ID: 71215
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(CC1C=C(CCC=C(C)C)C(=O)O1)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -5.8
InChIKey:VWVDFIOPTDDPHK-UHFFFAOYSA-N
ID: 71216
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(O)(C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.4
InChIKey:LNRNVJSETADUGG-UHFFFAOYSA-N
ID: 71217
SMILES:CC(C(=O)c1c2c(c(C(CCC(C)C)=O)c(O)c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.765
InChIKey:GEOOEPQQMPNYHG-UHFFFAOYSA-N
ID: 71218
SMILES:C(CC=C(C)CCC=C(C)C)C(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 71219
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(C(C(C)C)=O)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.758
InChIKey:DRBLQEYTTYIRBE-UHFFFAOYSA-N
ID: 71220
SMILES:C(C=C(CCC=C(CCC=C(C)C)C)C)c1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 71221
SMILES:C1(O)C(c2c(O)cc(CCCCC)cc2)OC(C)(C)C1CCC(O)(C)C=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -15.374
InChIKey:ZJOVDYCTEVTOCV-UHFFFAOYSA-N
ID: 71222
SMILES:c1(CCCCC)cc(C2C(C(C)=C)CCC(C)=C2)c(O)c(CC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.153
InChIKey:JDAHZYCBJHTXFD-UHFFFAOYSA-N
ID: 71223
SMILES:CC1(C)C2C(C)(Oc3c(c(O)cc(CCC)c3)C2)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 288.431
CB1 binding score: -18.4
InChIKey:IYJFZOBKCYBWAD-UHFFFAOYSA-N
ID: 71224
SMILES:c1(CCCCC)ccc(OC)c2c1OC1(C)CCC(C(C)C)C3C1C2OC3=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -18.956
InChIKey:YOUTVSVEVGMXFL-UHFFFAOYSA-N
ID: 71225
SMILES:c12ccc(OC)c(OCC)c(=O)c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.347
InChIKey:AROLFOOVIOXQBF-UHFFFAOYSA-N
ID: 71226
SMILES:C(CCCCCCC)CCCc1cc(O)c2c(c1)OC(C)(C)C=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.445
InChIKey:NXAKQJUHTMKEQA-UHFFFAOYSA-N
ID: 71227
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 71228
SMILES:CCCCCc1cc(OC)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 71229
SMILES:C1CCC(C)(C)C(c2cc(CCCCC)cc(CC=C(C)C)c2O)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.578
CB1 binding score: -15.826
InChIKey:VQTWVVGJJFZZOZ-UHFFFAOYSA-N
ID: 71230
SMILES:CC(C1Oc2c(c(O)cc(CCC)c2)C2CC(=C)CCC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.062
InChIKey:UAOQPYBXLONZAV-UHFFFAOYSA-N
ID: 71231
SMILES:NCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(COC(C)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.439
CB1 binding score: -17.701
InChIKey:AKZLNPIWJGXBFB-UHFFFAOYSA-N
ID: 71232
SMILES:C(CCC)Cc1cccc2c1C(=O)OC2(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.448
InChIKey:DCIJZBKTZKVRDO-UHFFFAOYSA-N