ID: 69301
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=CCC(C)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.458
InChIKey:CLZONKRNYCQUPK-UHFFFAOYSA-N
ID: 69302
SMILES:Oc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 69303
SMILES:C(O)C1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.888
InChIKey:PQLHCGPBCSGLBO-UHFFFAOYSA-N
ID: 69304
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -17.626
InChIKey:MEJORJUZOQABHU-UHFFFAOYSA-N
ID: 69305
SMILES:O1C2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -19.296
InChIKey:GEMPDHCIWOATES-UHFFFAOYSA-N
ID: 69306
SMILES:O=C(c1c(CC)cc(O)c2c1OC1C3C(C(O)CC(C)=C3)C(C)(C)OC21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.643
InChIKey:SSVDGPXUDCTWPX-UHFFFAOYSA-N
ID: 69307
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)C1=CCC2C(CC1C)OC(=O)C2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -15.05
InChIKey:PJSHDYTVGNAUTO-UHFFFAOYSA-N
ID: 69308
SMILES:c1(CC=C(C)CCC=C(C)C)c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 69309
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 69310
SMILES:c1(C2C(C(C)C)CC(=O)C(C)=C2)c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -15.633
InChIKey:ZUJFSWXWASLXQT-UHFFFAOYSA-N
ID: 69311
SMILES:c1c(C)c2c(c(C)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -17.282
InChIKey:RXHBPLHEPLQOLE-UHFFFAOYSA-N
ID: 69312
SMILES:CC(C)=CCCC(C)=CC1Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.988
InChIKey:LDOUDFXMJSPDLI-UHFFFAOYSA-N
ID: 69313
SMILES:CC(=CCCC1(C)OC1Cc1c(O)c2c(c(C=O)c1O)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.944
InChIKey:VEGRSVQGIYAADR-UHFFFAOYSA-N
ID: 69314
SMILES:C1C2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C(C)(O)C1)CC2C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -16.236
InChIKey:CNTOCJQUEZTHEY-UHFFFAOYSA-N
ID: 69315
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)C2CC3(C(C)(O1)CCCC3(C)C)C=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -15.735
InChIKey:JWPGSTRCWILYED-UHFFFAOYSA-N
ID: 69316
SMILES:c12c(O)cc(CCCCC)cc1OC(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: 69317
SMILES:c1(CCCCC)cc2c(c(O)c1)-c1c(O)c(C(C)C)c(O)c(O)c1CCC(C(C)=C)CC=C(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -14.34
InChIKey:JOSGCPWXWXADOS-UHFFFAOYSA-N
ID: 69318
SMILES:C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1OC1OC(CO)C(O)C(O)C1O)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.635
CB1 binding score: -16.152
InChIKey:RKVUGINXCOWYNG-UHFFFAOYSA-N
ID: 69319
SMILES:C(c1cc2c(cc1)C(C)(C)Oc1c-2c(OC)cc(CCCCC)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.504
InChIKey:IYWFGNVGINWROU-UHFFFAOYSA-N
ID: 69320
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccc(C(=O)O)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -19.478
InChIKey:HNVKFYQXRFNXOU-UHFFFAOYSA-N
ID: 69321
SMILES:C(C=C(C)C)CC1(C)Oc2c(c(OCC=C(C)C)cc(CCCCC)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.798
InChIKey:JWHIEHUDDGTTIA-UHFFFAOYSA-N